Monomers

Dicyclopentadiene

Identifiers

IUPAC name
tricyclo[5.2.1.02,6]deca-3,8-diene
InchI
InChI=1S/C10H12/c1-2-9-7-4-5-8(6-7)10(9)3-1/h1-2,4-5,7-10H,3,6H2
InchI Key
HECLRDQVFMWTQS-UHFFFAOYSA-N
SMILES
C1=CC2C(C1)C1C=CC2C1
Canonical SMILES
C1C=CC2C1C3CC2C=C3
Isomeric SMILES
C1C=CC2C1C3CC2C=C3
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H12
Heavy Atom Count
10
Molecular Weight
132.206
Exact Molecular Weight
132.0939
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
2.3846
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
3
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
3
Aromatic Rings
0

MOL File


     RDKit          3D

 22 24  0  0  0  0  0  0  0  0999 V2000
    1.9430    0.6849    0.5236 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0392    1.3914   -0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1984    0.5579   -1.0111 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5553   -0.8446   -0.5447 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8633   -0.7546    0.1705 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6071   -1.1647    0.3424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8114   -0.1101    1.3975 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2819    1.0056    0.8295 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2536    0.7360   -0.6343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7362   -0.7248   -0.6135 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6702    1.0703    1.2288 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9435    2.4632    0.0095 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3914    0.7093   -2.0780 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5528   -1.5517   -1.3876 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9891   -1.4265    1.0124 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6688   -0.9453   -0.5870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7027   -2.1683    0.6865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6138   -0.2285    2.4361 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6147    1.9137    1.3049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8304    1.3810   -1.2469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6457   -1.1977   -1.5864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7175   -0.7966   -0.1333 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
  5  1  1  0
 10  6  1  0
  9  3  1  0
  1 11  1  0
  2 12  1  0
  3 13  1  0
  4 14  1  0
  5 15  1  0
  5 16  1  0
  6 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers